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Cay10487, o,o'-bis(pentafluoropropionyl)-

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Cay10487, o,o'-bis(pentafluoropropionyl)-
SpectraBase Compound ID FGH7Gxzp32V
InChI InChI=1S/C19H13F10NO7/c1-8(13(32)35-2)30-12(31)6-4-9-3-5-10(36-14(33)16(20,21)18(24,25)26)11(7-9)37-15(34)17(22,23)19(27,28)29/h3-8H,1-2H3,(H,30,31)/b6-4-/t8-/m1/s1
InChIKey XWVNXTYHWKTEMT-RZAAKKIOSA-N
Mol Weight 557.3 g/mol
Molecular Formula C19H13F10NO7
Exact Mass 557.053233 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3Q5ttqjPNaP
Name Cay10487, o,o'-bis(pentafluoropropionyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 557.053233386 u
Formula C19H13F10NO7
InChI InChI=1S/C19H13F10NO7/c1-8(13(32)35-2)30-12(31)6-4-9-3-5-10(36-14(33)16(20,21)18(24,25)26)11(7-9)37-15(34)17(22,23)19(27,28)29/h3-8H,1-2H3,(H,30,31)/b6-4-/t8-/m1/s1
InChIKey XWVNXTYHWKTEMT-RZAAKKIOSA-N
Molecular Weight 557.297 g/mol
SMILES COC(=O)[C@@](C)(NC(=O)\C=C/C1=CC=C(OC(C(C(F)(F)F)(F)F)=O)C(=C1)OC(C(C(F)(F)F)(F)F)=O)[H]